About hydroxy-dimethyl-[1-(4-methylpent-4-en-2-yloxy)hexyl]silane
hydroxy-dimethyl-[1-(4-methylpent-4-en-2-yloxy)hexyl]silane (PubChem CID 10777637) has the molecular formula C14H30O2Si
and a molecular weight of 258.48 g/mol. Its IUPAC name is hydroxy-dimethyl-[1-(4-methylpent-4-en-2-yloxy)hexyl]silane.
Molecular Properties
| Compound Name | hydroxy-dimethyl-[1-(4-methylpent-4-en-2-yloxy)hexyl]silane |
| PubChem CID | 10777637 |
| Molecular Formula | C14H30O2Si |
| Molecular Weight | 258.48 g/mol |
| Exact Mass | 258.20 |
| IUPAC Name | hydroxy-dimethyl-[1-(4-methylpent-4-en-2-yloxy)hexyl]silane |
| SMILES | C=C(C)CC(C)OC(CCCCC)[Si](C)(C)O |
| InChI | InChI=1S/C14H30O2Si/c1-7-8-9-10-14(17(5,6)15)16-13(4)11-12(2)3/h13-15H,2,7-11H2,1,3-6H3 |
| InChIKey | GAEAQSVVDAUCNW-UHFFFAOYSA-N |
| XLogP | 4.04 |
| TPSA | 29.46 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 258.48 |
| LogP ≤ 5 | 4.04 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of hydroxy-dimethyl-[1-(4-methylpent-4-en-2-yloxy)hexyl]silane?
The IUPAC name of hydroxy-dimethyl-[1-(4-methylpent-4-en-2-yloxy)hexyl]silane (CID 10777637) is hydroxy-dimethyl-[1-(4-methylpent-4-en-2-yloxy)hexyl]silane.
What is the SMILES notation for hydroxy-dimethyl-[1-(4-methylpent-4-en-2-yloxy)hexyl]silane?
The canonical SMILES for hydroxy-dimethyl-[1-(4-methylpent-4-en-2-yloxy)hexyl]silane is C=C(C)CC(C)OC(CCCCC)[Si](C)(C)O.
What is the InChIKey of hydroxy-dimethyl-[1-(4-methylpent-4-en-2-yloxy)hexyl]silane?
The InChIKey is GAEAQSVVDAUCNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O2Si/c1-7-8-9-10-14(17(5,6)15)16-13(4)11-12(2)3/h13-15H,2,7-11H2,1,3-6H3.
What are the key properties of hydroxy-dimethyl-[1-(4-methylpent-4-en-2-yloxy)hexyl]silane?
hydroxy-dimethyl-[1-(4-methylpent-4-en-2-yloxy)hexyl]silane has a molecular weight of 258.48 g/mol, XLogP of 4.04, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-dimethyl-[1-(4-methylpent-4-en-2-yloxy)hexyl]silane is sourced from PubChem (CID 10777637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).